Benzenecarbothioic acid, O-(phenylmethyl) ester

Base Information

Chemical Name:Benzenecarbothioic acid, O-(phenylmethyl) ester
CAS No.:7459-69-0
Molecular Formula:C14H12OS
Molecular Weight:228.315
Hs Code.:
DSSTox Substance ID:DTXSID00448867
Nikkaji Number:J1.096.911E
Wikidata:Q82268052

Synonyms:Benzylthiobenzoat;Benzenecarbothioic acid, O-(phenylmethyl) ester;7459-69-0;SCHEMBL5597240;Thiobenzoic acid O-benzyl ester;DTXSID00448867

Suppliers and Price of Benzenecarbothioic acid, O-(phenylmethyl) ester

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Total 1 raw suppliers

Chemical Property of Benzenecarbothioic acid, O-(phenylmethyl) ester

Chemical Property:

XLogP3:4.6
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:4
Exact Mass:228.06088618
Heavy Atom Count:16
Complexity:215

Purity/Quality:: 95% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC=C(C=C1)COC(=S)C2=CC=CC=C2

Technology Process of Benzenecarbothioic acid, O-(phenylmethyl) ester

There total 20 articles about Benzenecarbothioic acid, O-(phenylmethyl) ester which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 89.0%

: 220642-23-9
1-thiobenzoyl-6-nitrobenzotriazole

: 100-51-6,185532-71-2
benzyl alcohol

: 7459-69-0
benzyl thionobenzoate

Guidance literature:: With 1,8-diazabicyclo[5.4.0]undec-7-ene; In tetrahydrofuran; at 0 - 25 ℃; for 1h;
DOI:10.1021/jo981985u

Reference yield: 81.0%

: tert-butyl phenyl(phenylcarbonothioyl)carbamate

: 100-51-6,185532-71-2
benzyl alcohol

: 7459-69-0
benzyl thionobenzoate

Guidance literature:: With potassium phosphate; palladium diacetate; tris(pentafluorophenyl)phosphine; In toluene; at 110 ℃; for 12h; Reagent/catalyst; Solvent; Temperature; Catalytic behavior; Inert atmosphere; Sealed tube;
DOI:10.1039/d1ob02349g

Reference yield: 75.0%

: tert-butyl (4-methoxyphenyl)(phenylcarbonothioyl)carbamate

: 100-51-6,185532-71-2
benzyl alcohol

: 7459-69-0
benzyl thionobenzoate

Guidance literature:: With potassium phosphate; palladium diacetate; tris(pentafluorophenyl)phosphine; In toluene; at 110 ℃; for 12h; Inert atmosphere; Sealed tube;
DOI:10.1039/d1ob02349g